EGFR/ErbB-2 inhibitor

Ligand id: 5964

Name: EGFR/ErbB-2 inhibitor

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 65.5
Molecular weight 387.16
XLogP 5.65
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

View interactive charts of activity data from GtoPdb and ChEMBL (where available) across species

Bioactivity Comments
Treatment with a 10μM solution of this compound inhibits EGFR activity by 97% [4].
Selectivity at catalytic receptors
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
epidermal growth factor receptor Hs Inhibitor Inhibition 7.7 pIC50 - 2
pIC50 7.7 (IC50 2x10-8 M) [2]
erb-b2 receptor tyrosine kinase 2 Hs Inhibitor Inhibition 7.1 pIC50 - 2
pIC50 7.1 (IC50 7.9x10-8 M) [2]